N-[4-(4-cyclopropylcarbonyl-1,4-diazepan-1-yl)phenyl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[4-(4-cyclopropylcarbonyl-1,4-diazepan-1-yl)phenyl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[4-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]phenyl]-2-(2-thienyl)acetamide CAS Name: N-[4-[4-[cyclopropyl(oxo)methyl]-1,4-diazepan-1-yl]phenyl]-2-thiophen-2-ylacetamide IUPAC Name: N-[4-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]phenyl]-2-thiophen-2-ylacetamide Traditional Name: N-[4-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]phenyl]-2-(2-thienyl)acetamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2CC2)C3=CC=C(C=C3)NC(=O)CC4=CC=CS4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2CC2)C3=CC=C(C=C3)NC(=O)CC4=CC=CS4

InChI

InChI=1S/C21H25N3O2S/c25-20(15-19-3-1-14-27-19)22-17-6-8-18(9-7-17)23-10-2-11-24(13-12-23)21(26)16-4-5-16/h1,3,6-9,14,16H,2,4-5,10-13,15H2,(H,22,25)